Ligand name: 2-(4-METHYLPIPERAZIN-1-YL)-3,4,5,6,7,8-HEXAHYDROQUINAZOLIN-4-ONE
PDB ligand accession: WLH
DrugBank: n/a
PubChem: 208781;5294264;135417158;
ChEMBL: CHEMBL3593716
InChI Key: SQCWABLHLAOJBR-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C2=NC3=C(CCCC3)C(=O)N2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein Q9H2K2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5AL4	Download	Experimental	e5al4A1 e5al4B1	ADP-ribosylation ADP-ribosylation	LigPlot